2-[(5-chloranyl-1,3-benzothiazol-2-yl)sulfanyl]-1-phenothiazin-10-yl-ethanone

Systemtic Name: 2-[(5-chloranyl-1,3-benzothiazol-2-yl)sulfanyl]-1-phenothiazin-10-yl-ethanone Openeye Name: 2-[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]-1-phenothiazin-10-yl-ethanone CAS Name: 2-[(5-chloro-1,3-benzothiazol-2-yl)thio]-1-(10-phenothiazinyl)ethanone IUPAC Name: 2-[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]-1-phenothiazin-10-ylethanone Traditional Name: 2-[(5-chloro-1,3-benzothiazol-2-yl)thio]-1-phenothiazin-10-yl-ethanone Formula: C21H13ClN2OS3 MolecularWeight: 440.98872

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N(C3=CC=CC=C3S2)C(=O)CSC4=NC5=C(S4)C=CC(=C5)Cl

Isomeric SMILES

C1=CC=C2C(=C1)N(C3=CC=CC=C3S2)C(=O)CSC4=NC5=C(S4)C=CC(=C5)Cl

InChI

InChI=1S/C21H13ClN2OS3/c22-13-9-10-17-14(11-13)23-21(28-17)26-12-20(25)24-15-5-1-3-7-18(15)27-19-8-4-2-6-16(19)24/h1-11H,12H2